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Matematicheskoe modelirovanie, 2010, Volume 22, Number 11, Pages 39–48 (Mi mm3039)  
This article is cited in 12 scientific papers (total in 12 papers)

Molecular dynamics method for simulation of thermodynamic equilibrium

V. O. Podryga

Lomonosov MSU, CMC
Full-text PDF (185 kB) Citations (12)
References:
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Abstract: In this article we consider the application of molecular dynamics method for a system of argon atoms. An original molecular dynamics program, calculating the characteristics of gases on the basis of the Lennard-Jones potential, is developed. Conservative system in the process of calculation is ensured by optimizing the value of the time step. The process of establishing the equilibrium distribution of atoms in velocity is investigated.
Keywords: molecular dynamics, Lennard-Jones, argon, temperature.
Received: 23.04.2010
English version:
Mathematical Models and Computer Simulations, 2011, Volume 3, Issue 3, Pages 382–388
DOI: https://doi.org/10.1134/S2070048211030112
Bibliographic databases:
Document Type: Article
UDC: 519.6
Language: Russian
Citation: V. O. Podryga, “Molecular dynamics method for simulation of thermodynamic equilibrium”, Mat. Model., 22:11 (2010), 39–48; Math. Models Comput. Simul., 3:3 (2011), 382–388
Citation in format AMSBIB
\Bibitem{Pod10}
\by V.~O.~Podryga
\paper Molecular dynamics method for simulation of thermodynamic equilibrium
\jour Mat. Model.
\yr 2010
\vol 22
\issue 11
\pages 39--48
\mathnet{http://mi.mathnet.ru/mm3039}
\transl
\jour Math. Models Comput. Simul.
\yr 2011
\vol 3
\issue 3
\pages 382--388
\crossref{https://doi.org/10.1134/S2070048211030112}
\scopus{https://www.scopus.com/record/display.url?origin=inward&eid=2-s2.0-84928989483}
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  • https://www.mathnet.ru/eng/mm/v22/i11/p39
    • This publication is cited in the following 12 articles:
    1. Viktoriia O. Podryga, Sergey V. Polyakov, Smart Innovation, Systems and Technologies, 215, Smart Modelling for Engineering Systems, 2021, 9  crossref
    2. Polyakov S.V., Podryga V.O., Puzyrkov D.V., “High Performance Computing in Multiscale Problems of Gas Dynamics”, Lobachevskii J. Math., 39:9 (2018), 1239–1250  crossref  mathscinet  isi
    3. Kudryashova T., Karamzin Yu., Podryga V., Polyakov S., “Two-Scale Computation of N-2-H-2 Jet Flow Based on Qgd and Mmd on Heterogeneous Multi-Core Hardware”, Adv. Eng. Softw., 120:2, SI (2018), 79–87  crossref  isi
    4. Podryga V. Polyakov S., “Calculation of Nitrogen Flow in Nickel Micronozzle Based on Numerical Approaches of Gas and Molecular Dynamics”, V International Conference on Particle-Based Methods - Fundamentals and Applications (Particles 2017), ed. Wriggers P. Bischoff M. Onate E. Owen D. Zohdi T., Int Center Numerical Methods Engineering, 2017, 744–754  isi
    5. Viktoriia O. Podryga, Lecture Notes in Computer Science, 10187, Numerical Analysis and Its Applications, 2017, 542  crossref
    6. Sergey Polyakov, Viktoriia Podryga, Dmitry Puzyrkov, Tatiana Kudryashova, Communications in Computer and Information Science, 687, Supercomputing, 2016, 185  crossref
    7. V. O. Podryga, “Multiscale approach to computation of three-dimensional gas mixture flows in engineering microchannels”, Dokl. Math., 94:1 (2016), 458  crossref
    8. V O Podryga, “Computational technology of multiscale modeling the gas flows in microchannels”, IOP Conf. Ser.: Mater. Sci. Eng., 158 (2016), 012078  crossref
    9. V. O. Podryga, “Opredelenie makroparametrov realnogo gaza metodami molekulyarnoi dinamiki”, Matem. modelirovanie, 27:7 (2015), 80–90  mathnet  elib
    10. Podryga V., Polyakov S., “Correction of the Gas Flow Parameters By Molecular Dynamics”, Particle-Based Methods Iv-Fundamentals and Applications, eds. Onate E., Bischoff M., Owen D., Wriggers P., Zohdi T., Int Center Numerical Methods Engineering, 2015, 779–788  isi
    11. M. D. Bragin, A. V. Ivanov, “Lokalno-adaptivnyi vybor shaga integrirovaniya v zadachakh molekulyarnoi dinamiki”, Preprinty IPM im. M. V. Keldysha, 2013, 062, 39 pp.  mathnet
    12. V. O. Podryga, “Modelirovanie protsessa ustanovleniya termodinamicheskogo ravnovesiya nagretogo metalla”, Matem. modelirovanie, 23:9 (2011), 105–119  mathnet
    Citing articles in Google Scholar: Russian citations, English citations
    Related articles in Google Scholar: Russian articles, English articles
    		Математическое моделирование
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